{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8587154 -1.979005 0.8198859 ] [ -1.6959076 1.6323958 -1.9273288 ] [ 0.6333028 0.1012888 2.7708158 ] [ 6.3314099 -8.9244705 -21.1571972 ] [ 0.1428956 -2.0463433 30.9195869 ] [ -2.5529852 11.2161342 -11.4257627 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.58016697940092e-09 -3.170715543446304e-09 1.313602020703567e-09 ] [ -2.717143507757038e-09 2.615386386652113e-09 -3.087921143954519e-09 ] [ 1.014662940047178e-09 1.62282547308887e-10 4.439336295303249e-09 ] [ 1.014403691848167e-08 -1.429857798811929e-08 -3.389756671549522e-08 ] [ 2.289439895351885e-10 -3.278603393390721e-09 4.953863925597395e-08 ] [ -4.090333200688413e-09 1.797022799099531e-08 -1.830608987274868e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.4025072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.24706424634367e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2112892 0.5810984 1.9828898 ] [ -0.0258792 2.6887715 0.5352226 ] [ 1.0949339 2.8894223 2.8369149 ] [ 3.4837619 1.1045712 1.1857449 ] [ 2.4339118 0.7393037 3.2592897 ] [ 2.1001278 2.2011508 -0.3465456 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.112892e-11 5.810984e-11 1.9828898e-10 ] [ -2.58792e-12 2.6887715e-10 5.352226e-11 ] [ 1.0949339e-10 2.8894223e-10 2.8369149e-10 ] [ 3.4837619e-10 1.1045712e-10 1.1857449e-10 ] [ 2.4339118e-10 7.393037e-11 3.2592897e-10 ] [ 2.1001278e-10 2.2011508e-10 -3.465456e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 -3.1e-06 -6.2e-06 ] [ -1.44e-05 4.8e-06 -5.9e-06 ] [ 1.83e-05 -1.9e-06 -1.13e-05 ] [ 9.6e-06 2.6e-06 6.3e-06 ] [ -4e-06 -6e-06 1.31e-05 ] [ -1.06e-05 3.6e-06 3.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.76239428288e-15 -4.96674752448e-15 -9.93349504896e-15 ] [ -2.307134333952e-14 7.69044777984e-15 -9.45284206272e-15 ] [ 2.931983216064e-14 -3.04413557952e-15 -1.810459581504e-14 ] [ 1.538089555968e-14 4.16565921408e-15 1.009371271104e-14 ] [ -6.4087064832e-15 -9.6130597248e-15 2.098851373248e-14 ] [ -1.698307218048e-14 5.76783583488e-15 6.24848882112e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.482302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.320320567976508e-18 } }